3-(2,2-dimethylpropanoylamino)-N-(1,3-dioxoisoindol-2-yl)-2-methylbenzamide
TL;DR: 3-(2,2-dimethylpropanoylamino)-N-(1,3-dioxoisoindol-2-yl)-2-methylbenzamide (CAS 518007-14-2) is a chemical compound with molecular formula C21H21N3O4 and molecular weight 379.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,2-dimethylpropanoylamino)-N-(1,3-dioxoisoindol-2-yl)-2-methylbenzamide
Also Known As: 3-(2,2-dimethylpropanoylamino)-N-(1,3-dioxoisoindol-2-yl)-2-methylbenzamide, 3-[(2,2-dimethylpropanoyl)amino]-N-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-2-methylbenzamide
| Molecular Formula | C21H21N3O4 |
|---|---|
| Molecular Weight | 379.15 g/mol |
| LogP | 2.92062 |
| Topological Polar Surface Area | 95.58 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 379.1532 |
| Heavy Atoms | 28 |
| Complexity | 969.95056 |
Chemical Identifiers
| CAS Number | 518007-14-2 |
|---|---|
| SMILES | CC1=C(C=CC=C1NC(=O)C(C)(C)C)C(=O)NN2C(=O)C3=CC=CC=C3C2=O |
Product Overview
3-(2,2-dimethylpropanoylamino)-N-(1,3-dioxoisoindol-2-yl)-2-methylbenzamide (CAS 518007-14-2), with molecular formula C21H21N3O4 and molecular weight 379.15 g/mol. IUPAC: 3-(2,2-dimethylpropanoylamino)-N-(1,3-dioxoisoindol-2-yl)-2-methylbenzamide.
Chemical Property Profile of 3-(2,2-dimethylpropanoylamino)-N-(1,3-dioxoisoindol-2-yl)-2-methylbenzamide
Property Insights of 3-(2,2-dimethylpropanoylamino)-N-(1,3-dioxoisoindol-2-yl)-2-methylbenzamide
The XLogP value of 2.92062 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2,2-dimethylpropanoylamino)-N-(1,3-dioxoisoindol-2-yl)-2-methylbenzamide. The TPSA of 95.58 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2,2-dimethylpropanoylamino)-N-(1,3-dioxoisoindol-2-yl)-2-methylbenzamide. Following Lipinski's Rule of Five, 3-(2,2-dimethylpropanoylamino)-N-(1,3-dioxoisoindol-2-yl)-2-methylbenzamide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(2,2-dimethylpropanoylamino)-N-(1,3-dioxoisoindol-2-yl)-2-methylbenzamide?
The CAS number of 3-(2,2-dimethylpropanoylamino)-N-(1,3-dioxoisoindol-2-yl)-2-methylbenzamide is 518007-14-2.
What is the molecular formula of 3-(2,2-dimethylpropanoylamino)-N-(1,3-dioxoisoindol-2-yl)-2-methylbenzamide?
The molecular formula of 3-(2,2-dimethylpropanoylamino)-N-(1,3-dioxoisoindol-2-yl)-2-methylbenzamide is C21H21N3O4.
What is the molecular weight of 3-(2,2-dimethylpropanoylamino)-N-(1,3-dioxoisoindol-2-yl)-2-methylbenzamide?
The molecular weight of 3-(2,2-dimethylpropanoylamino)-N-(1,3-dioxoisoindol-2-yl)-2-methylbenzamide is 379.15 g/mol.
Where can I buy 3-(2,2-dimethylpropanoylamino)-N-(1,3-dioxoisoindol-2-yl)-2-methylbenzamide?
You can request a quote for 3-(2,2-dimethylpropanoylamino)-N-(1,3-dioxoisoindol-2-yl)-2-methylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2,2-dimethylpropanoylamino)-N-(1,3-dioxoisoindol-2-yl)-2-methylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(2,2-dimethylpropanoylamino)-N-(1,3-dioxoisoindol-2-yl)-2-methylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.